On the stress overshoot in cluster crystals under shear

preprint2020arXivOpen access

Abstract

Using non-equilibrium molecular dynamics simulations we study the yielding behaviour of a model cluster crystal formed by ultrasoft particles under shear. We investigate the evolution of stress as a function of strain for different shear rates, γ˙\dotγ, and temperatures. The stress-strain relation displays a pronounced maximum at the yielding point; the height of this maximum, σpσ_\text{p}, increases via a power law with an increasing shear range and tends to saturate to a finite value if the limit shear rate goes to zero (at least within the considered temperature range). Interestingly, this behaviour can be captured by the Herschel-Bulkley type model which, for a given temperature, allows us to predict a static yield stress σp0σ^{0}_\text{p} (in the shear rate tending to zero limit), a characteristic timescale τcτ_\text{c}, and the exponent αα of the above-mentioned power-law decay of the σpσ_\text{p} at high shear rates. Furthermore, for different temperatures, the σpσ_\text{p} can be scaled as functions of γ˙\dotγ onto a single master curve when scaled by corresponding τcτ_\text{c} and σp0σ_\text{p}^{0}. Moreover, for a given shear rate, σpσ_\text{p} displays a logarithmic dependence on temperature. Again, the σp−Tσ_\text{p}{-}T curves for different shear rates can be scaled on a single logarithmic master curve when scaled by a corresponding fitting parameters.

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